| SpectraBase Compound ID | oyPLH0ZyP5 |
|---|---|
| InChI | InChI=1S/C15H28O2/c1-4-5-6-7-8-9-10-11-12-13-17-15(16)14(2)3/h4,14H,1,5-13H2,2-3H3 |
| InChIKey | LMPNNKURYJRMQR-UHFFFAOYSA-N |
| Mol Weight | 240.39 g/mol |
| Molecular Formula | C15H28O2 |
| Exact Mass | 240.20893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8xrJdHGhLgD |
|---|---|
| Name | Isobutyric acid, undec-10-enyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.208930140 u |
| Formula | C15H28O2 |
| InChI | InChI=1S/C15H28O2/c1-4-5-6-7-8-9-10-11-12-13-17-15(16)14(2)3/h4,14H,1,5-13H2,2-3H3 |
| InChIKey | LMPNNKURYJRMQR-UHFFFAOYSA-N |
| Molecular Weight | 240.387 g/mol |
| SMILES | C=CCCCCCCCCCOC(=O)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963646 |